2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine

C8H11N5 — CID 84767353

IUPAC2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine
SMILESCC(C)(N)c1cnc2ncnn2c1
InChIInChI=1S/C8H11N5/c1-8(2,9)6-3-10-7-11-5-12-13(7)4-6/h3-5H,9H2,1-2H3
InChIKeyBZDBRLRWPGWLEW-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.32
Rot. Bonds1

About 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine

2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine (PubChem CID 84767353) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine.

Molecular Properties

Compound Name2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine
PubChem CID84767353
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine
SMILESCC(C)(N)c1cnc2ncnn2c1
InChIInChI=1S/C8H11N5/c1-8(2,9)6-3-10-7-11-5-12-13(7)4-6/h3-5H,9H2,1-2H3
InChIKeyBZDBRLRWPGWLEW-UHFFFAOYSA-N
XLogP0.32
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 159341106
6-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 1476026
2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-amine
CID 84767352
2-amino-1-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 84767265
2-(2-propan-2-ylpyrazolo[1,5-a]pyrimidin-6-yl)propan-2-amine
CID 84786283
2-(2-methylpyrimidin-5-yl)propan-2-amine
CID 82417261
6-(2-phenylethynyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 50913149
[1,2,4]triazolo[5,1-c][1,2,4]triazin-3-amine
CID 170774084
3-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-ol
CID 15578993
2-(methylamino)-1-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol
CID 84772647
6-(2-chloro-4,5-dimethylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 59805865
3-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid
CID 84772253

Frequently Asked Questions

What is the IUPAC name of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine?
The IUPAC name of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine (CID 84767353) is 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine.
What is the SMILES notation for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine?
The canonical SMILES for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine is CC(C)(N)c1cnc2ncnn2c1.
What is the InChIKey of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine?
The InChIKey is BZDBRLRWPGWLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-8(2,9)6-3-10-7-11-5-12-13(7)4-6/h3-5H,9H2,1-2H3.
What are the key properties of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine?
2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine has a molecular weight of 177.21 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine is sourced from PubChem (CID 84767353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).